N-[1-[(4-fluorophenyl)carbamothioyl]piperidin-4-yl]-4-methoxy-benzamide

Systemtic Name: N-[1-[(4-fluorophenyl)carbamothioyl]piperidin-4-yl]-4-methoxy-benzamide Openeye Name: N-[1-[(4-fluorophenyl)carbamothioyl]-4-piperidyl]-4-methoxy-benzamide CAS Name: N-[1-[(4-fluoroanilino)-sulfanylidenemethyl]-4-piperidinyl]-4-methoxybenzamide IUPAC Name: N-[1-[(4-fluorophenyl)carbamothioyl]piperidin-4-yl]-4-methoxybenzamide Traditional Name: N-[1-[(4-fluorophenyl)thiocarbamoyl]-4-piperidyl]-4-methoxy-benzamide Formula: C20H22FN3O2S MolecularWeight: 387.470983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2CCN(CC2)C(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2CCN(CC2)C(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O2S/c1-26-18-8-2-14(3-9-18)19(25)22-17-10-12-24(13-11-17)20(27)23-16-6-4-15(21)5-7-16/h2-9,17H,10-13H2,1H3,(H,22,25)(H,23,27)